PUBCHEM-ZINC05976155 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 0.7100 1.9970 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 0.5360 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 0.0390 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 0.2820 1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 0.6230 1.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 0.1040 3.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -0.2160 4.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 0.4160 3.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 0.5970 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 1.1550 1.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -1.7310 4.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 0.3510 5.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.1610 -1.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -1.5930 -0.8990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8170 -1.8230 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -1.9340 -2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -1.5750 -1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1470 -0.2340 -1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 0.0960 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3440 -0.9150 -0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 -2.2540 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -2.5810 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6010 -0.5530 -0.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1010 -1.3640 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -2.4560 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -2.9100 -2.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 2.0850 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 2.3880 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 2.5940 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -2.2110 4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -1.9790 4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -2.1880 3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 1.4380 5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 0.1640 6.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -0.0680 5.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -1.0370 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -1.4160 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -3.0070 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 0.5600 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7500 1.1360 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 -3.0510 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 -3.6270 -1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -2.6270 0.0860 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 13 2 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 M CHG 1 43 -1 M END